4-(4-methylsulfonyl-1,4-diazepan-1-yl)-2-phenyl-quinazoline

Systemtic Name: 4-(4-methylsulfonyl-1,4-diazepan-1-yl)-2-phenyl-quinazoline Openeye Name: 4-(4-methylsulfonyl-1,4-diazepan-1-yl)-2-phenyl-quinazoline CAS Name: 4-(4-methylsulfonyl-1,4-diazepan-1-yl)-2-phenylquinazoline IUPAC Name: 4-(4-methylsulfonyl-1,4-diazepan-1-yl)-2-phenylquinazoline Traditional Name: 4-(4-mesyl-1,4-diazepan-1-yl)-2-phenyl-quinazoline Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C20H22N4O2S/c1-27(25,26)24-13-7-12-23(14-15-24)20-17-10-5-6-11-18(17)21-19(22-20)16-8-3-2-4-9-16/h2-6,8-11H,7,12-15H2,1H3