(2S,3S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-methyl-1-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)pentan-1-one

Systemtic Name: (2S,3S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-methyl-1-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)pentan-1-one Openeye Name: (2S,3S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-1-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)pentan-1-one CAS Name: (2S,3S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-1-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-1-pentanone IUPAC Name: (2S,3S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-1-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)pentan-1-one Traditional Name: (2S,3S)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-3-methyl-1-(1,3,4,5-tetrahydropyrid[4,3-b]indol-2-yl)pentan-1-one Formula: C24H26N4O3S MolecularWeight: 450.55324

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCC2=C(C1)C3=CC=CC=C3N2)NC4=NS(=O)(=O)C5=CC=CC=C54

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N1CCC2=C(C1)C3=CC=CC=C3N2)NC4=NS(=O)(=O)C5=CC=CC=C54

InChI

InChI=1S/C24H26N4O3S/c1-3-15(2)22(26-23-17-9-5-7-11-21(17)32(30,31)27-23)24(29)28-13-12-20-18(14-28)16-8-4-6-10-19(16)25-20/h4-11,15,22,25H,3,12-14H2,1-2H3,(H,26,27)/t15-,22-/m0/s1