(3R)-4-(4-methoxyphenyl)sulfonyl-3-[[1-[(1R)-6-[(2-methylpropylamino)methyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-1,2,3-triazol-4-yl]methyl]-1,3-dihydropyrazin-2-one

Systemtic Name: (3R)-4-(4-methoxyphenyl)sulfonyl-3-[[1-[(1R)-6-[(2-methylpropylamino)methyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-1,2,3-triazol-4-yl]methyl]-1,3-dihydropyrazin-2-one Openeye Name: (3R)-3-[[1-[(1R)-6-[(isobutylamino)methyl]tetralin-1-yl]triazol-4-yl]methyl]-4-(4-methoxyphenyl)sulfonyl-1,3-dihydropyrazin-2-one CAS Name: (3R)-4-(4-methoxyphenyl)sulfonyl-3-[[1-[(1R)-6-[(2-methylpropylamino)methyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-triazolyl]methyl]-1,3-dihydropyrazin-2-one IUPAC Name: (3R)-4-(4-methoxyphenyl)sulfonyl-3-[[1-[(1R)-6-[(2-methylpropylamino)methyl]-1,2,3,4-tetrahydronaphthalen-1-yl]triazol-4-yl]methyl]-1,3-dihydropyrazin-2-one Traditional Name: (3R)-3-[[1-[(1R)-6-[(isobutylamino)methyl]tetralin-1-yl]triazol-4-yl]methyl]-4-(4-methoxyphenyl)sulfonyl-1,3-dihydropyrazin-2-one Formula: C29H36N6O4S MolecularWeight: 564.69894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCC1=CC2=C(C=C1)C(CCC2)N3C=C(N=N3)CC4C(=O)NC=CN4S(=O)(=O)C5=CC=C(C=C5)OC

Isomeric SMILES

CC(C)CNCC1=CC2=C(C=C1)[C@@H](CCC2)N3C=C(N=N3)C[C@@H]4C(=O)NC=CN4S(=O)(=O)C5=CC=C(C=C5)OC

InChI

InChI=1S/C29H36N6O4S/c1-20(2)17-30-18-21-7-12-26-22(15-21)5-4-6-27(26)34-19-23(32-33-34)16-28-29(36)31-13-14-35(28)40(37,38)25-10-8-24(39-3)9-11-25/h7-15,19-20,27-28,30H,4-6,16-18H2,1-3H3,(H,31,36)/t27-,28-/m1/s1