6,7-dimethoxy-4-[(phenylmethyl)amino]-1H-quinazoline-2-thione

Systemtic Name: 6,7-dimethoxy-4-[(phenylmethyl)amino]-1H-quinazoline-2-thione Openeye Name: 4-(benzylamino)-6,7-dimethoxy-1H-quinazoline-2-thione CAS Name: 6,7-dimethoxy-4-[(phenylmethyl)amino]-1H-quinazoline-2-thione IUPAC Name: 4-(benzylamino)-6,7-dimethoxy-1H-quinazoline-2-thione Traditional Name: 4-(benzylamino)-6,7-dimethoxy-1H-quinazoline-2-thione Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=S)N2)NCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=S)N2)NCC3=CC=CC=C3)OC

InChI

InChI=1S/C17H17N3O2S/c1-21-14-8-12-13(9-15(14)22-2)19-17(23)20-16(12)18-10-11-6-4-3-5-7-11/h3-9H,10H2,1-2H3,(H2,18,19,20,23)