4-azanyl-5-(4-methoxyphenyl)carbonyl-2-(propan-2-ylamino)thiophene-3-carbonitrile

Systemtic Name: 4-azanyl-5-(4-methoxyphenyl)carbonyl-2-(propan-2-ylamino)thiophene-3-carbonitrile Openeye Name: 4-amino-2-(isopropylamino)-5-(4-methoxybenzoyl)thiophene-3-carbonitrile CAS Name: 4-amino-5-[(4-methoxyphenyl)-oxomethyl]-2-(propan-2-ylamino)-3-thiophenecarbonitrile IUPAC Name: 4-amino-5-(4-methoxybenzoyl)-2-(propan-2-ylamino)thiophene-3-carbonitrile Traditional Name: 4-amino-2-(isopropylamino)-5-p-anisoyl-thiophene-3-carbonitrile Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(C(=C(S1)C(=O)C2=CC=C(C=C2)OC)N)C#N

Isomeric SMILES

CC(C)NC1=C(C(=C(S1)C(=O)C2=CC=C(C=C2)OC)N)C#N

InChI

InChI=1S/C16H17N3O2S/c1-9(2)19-16-12(8-17)13(18)15(22-16)14(20)10-4-6-11(21-3)7-5-10/h4-7,9,19H,18H2,1-3H3