2-azanyl-5-(3,4-dimethoxyphenyl)sulfanyl-1H-indole-3-carbonitrile

Systemtic Name: 2-azanyl-5-(3,4-dimethoxyphenyl)sulfanyl-1H-indole-3-carbonitrile Openeye Name: 2-amino-5-(3,4-dimethoxyphenyl)sulfanyl-1H-indole-3-carbonitrile CAS Name: 2-amino-5-[(3,4-dimethoxyphenyl)thio]-1H-indole-3-carbonitrile IUPAC Name: 2-amino-5-(3,4-dimethoxyphenyl)sulfanyl-1H-indole-3-carbonitrile Traditional Name: 2-amino-5-[(3,4-dimethoxyphenyl)thio]-1H-indole-3-carbonitrile Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SC2=CC3=C(C=C2)NC(=C3C#N)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SC2=CC3=C(C=C2)NC(=C3C#N)N)OC

InChI

InChI=1S/C17H15N3O2S/c1-21-15-6-4-11(8-16(15)22-2)23-10-3-5-14-12(7-10)13(9-18)17(19)20-14/h3-8,20H,19H2,1-2H3