3-(3-methylphenyl)sulfanyl-8-oxidanylidene-acenaphthyleno[1,2-b]pyrrole-9-carbonitrile

Systemtic Name: 3-(3-methylphenyl)sulfanyl-8-oxidanylidene-acenaphthyleno[1,2-b]pyrrole-9-carbonitrile Openeye Name: 3-(m-tolylsulfanyl)-8-oxo-acenaphthyleno[1,2-b]pyrrole-9-carbonitrile CAS Name: 3-[(3-methylphenyl)thio]-8-oxo-9-acenaphthyleno[1,2-b]pyrrolecarbonitrile IUPAC Name: 3-(3-methylphenyl)sulfanyl-8-oxoacenaphthyleno[1,2-b]pyrrole-9-carbonitrile Traditional Name: 8-keto-3-(m-tolylthio)acenaphtho[1,2-b]pyrrole-9-carbonitrile Formula: C22H12N2OS MolecularWeight: 352.40848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SC2=C3C=CC=C4C3=C(C=C2)C5=C(C(=O)N=C45)C#N

Isomeric SMILES

CC1=CC(=CC=C1)SC2=C3C=CC=C4C3=C(C=C2)C5=C(C(=O)N=C45)C#N

InChI

InChI=1S/C22H12N2OS/c1-12-4-2-5-13(10-12)26-18-9-8-15-19-14(18)6-3-7-16(19)21-20(15)17(11-23)22(25)24-21/h2-10H,1H3