2-[[[(R)-(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[[(R)-(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[[(R)-(4-isopropylphenyl)-(2-thienyl)methyl]amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[[(R)-(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]amino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[[(R)-(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]amino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[[(R)-p-cumenyl(2-thienyl)methyl]amino]methyl]-1H-quinazolin-4-one Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[C@H](C2=CC=CS2)NCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C23H23N3OS/c1-15(2)16-9-11-17(12-10-16)22(20-8-5-13-28-20)24-14-21-25-19-7-4-3-6-18(19)23(27)26-21/h3-13,15,22,24H,14H2,1-2H3,(H,25,26,27)/t22-/m1/s1