2-[(phenylmethyl)amino]-6-(phenylsulfonyl)-5,6,7,8-tetrahydro-1H-quinazolin-4-one

Systemtic Name: 2-[(phenylmethyl)amino]-6-(phenylsulfonyl)-5,6,7,8-tetrahydro-1H-quinazolin-4-one Openeye Name: 6-(benzenesulfonyl)-2-(benzylamino)-5,6,7,8-tetrahydro-1H-quinazolin-4-one CAS Name: 6-(benzenesulfonyl)-2-[(phenylmethyl)amino]-5,6,7,8-tetrahydro-1H-quinazolin-4-one IUPAC Name: 6-(benzenesulfonyl)-2-(benzylamino)-5,6,7,8-tetrahydro-1H-quinazolin-4-one Traditional Name: 2-(benzylamino)-6-besyl-5,6,7,8-tetrahydro-1H-quinazolin-4-one Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1S(=O)(=O)C3=CC=CC=C3)C(=O)N=C(N2)NCC4=CC=CC=C4

Isomeric SMILES

C1CC2=C(CC1S(=O)(=O)C3=CC=CC=C3)C(=O)N=C(N2)NCC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O3S/c25-20-18-13-17(28(26,27)16-9-5-2-6-10-16)11-12-19(18)23-21(24-20)22-14-15-7-3-1-4-8-15/h1-10,17H,11-14H2,(H2,22,23,24,25)