N-cyclopentyl-2-[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: N-cyclopentyl-2-[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: N-cyclopentyl-2-[2-(2,5-dimethylphenyl)-2-oxo-ethyl]sulfanyl-3-(2-methoxyethyl)-4-oxo-quinazoline-7-carboxamide CAS Name: N-cyclopentyl-2-[[2-(2,5-dimethylphenyl)-2-oxoethyl]thio]-3-(2-methoxyethyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: N-cyclopentyl-2-[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl-3-(2-methoxyethyl)-4-oxoquinazoline-7-carboxamide Traditional Name: N-cyclopentyl-2-[[2-(2,5-dimethylphenyl)-2-keto-ethyl]thio]-4-keto-3-(2-methoxyethyl)quinazoline-7-carboxamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)NC4CCCC4)C(=O)N2CCOC

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)NC4CCCC4)C(=O)N2CCOC

InChI

InChI=1S/C27H31N3O4S/c1-17-8-9-18(2)22(14-17)24(31)16-35-27-29-23-15-19(25(32)28-20-6-4-5-7-20)10-11-21(23)26(33)30(27)12-13-34-3/h8-11,14-15,20H,4-7,12-13,16H2,1-3H3,(H,28,32)