3-methyl-2-methylsulfanyl-7-[[8-(2-pyrrol-1-ylphenyl)carbonyl-3,8-diazaspiro[4.5]decan-3-yl]carbonyl]quinazolin-4-one

Systemtic Name: 3-methyl-2-methylsulfanyl-7-[[8-(2-pyrrol-1-ylphenyl)carbonyl-3,8-diazaspiro[4.5]decan-3-yl]carbonyl]quinazolin-4-one Openeye Name: 3-methyl-2-methylsulfanyl-7-[8-(2-pyrrol-1-ylbenzoyl)-3,8-diazaspiro[4.5]decane-3-carbonyl]quinazolin-4-one CAS Name: 3-methyl-2-(methylthio)-7-[oxo-[8-[oxo-[2-(1-pyrrolyl)phenyl]methyl]-3,8-diazaspiro[4.5]decan-3-yl]methyl]-4-quinazolinone IUPAC Name: 3-methyl-2-methylsulfanyl-7-[8-(2-pyrrol-1-ylbenzoyl)-3,8-diazaspiro[4.5]decane-3-carbonyl]quinazolin-4-one Traditional Name: 3-methyl-2-(methylthio)-7-[8-(2-pyrrol-1-ylbenzoyl)-3,8-diazaspiro[4.5]decane-3-carbonyl]quinazolin-4-one Formula: C30H31N5O3S MolecularWeight: 541.66384

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC4(C3)CCN(CC4)C(=O)C5=CC=CC=C5N6C=CC=C6)N=C1SC

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC4(C3)CCN(CC4)C(=O)C5=CC=CC=C5N6C=CC=C6)N=C1SC

InChI

InChI=1S/C30H31N5O3S/c1-32-27(37)22-10-9-21(19-24(22)31-29(32)39-2)26(36)35-18-13-30(20-35)11-16-34(17-12-30)28(38)23-7-3-4-8-25(23)33-14-5-6-15-33/h3-10,14-15,19H,11-13,16-18,20H2,1-2H3