N-cycloheptyl-3-[(2-methoxyphenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-cycloheptyl-3-[(2-methoxyphenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-cycloheptyl-3-[(2-methoxyphenyl)methyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-cycloheptyl-3-[(2-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-cycloheptyl-3-[(2-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-cycloheptyl-4-keto-3-o-anisyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2C(=O)C3=C(C=C(C=C3)C(=O)NC4CCCCCC4)NC2=S

Isomeric SMILES

COC1=CC=CC=C1CN2C(=O)C3=C(C=C(C=C3)C(=O)NC4CCCCCC4)NC2=S

InChI

InChI=1S/C24H27N3O3S/c1-30-21-11-7-6-8-17(21)15-27-23(29)19-13-12-16(14-20(19)26-24(27)31)22(28)25-18-9-4-2-3-5-10-18/h6-8,11-14,18H,2-5,9-10,15H2,1H3,(H,25,28)(H,26,31)