2-azanyl-1-(2,4-dimethoxyphenyl)-5-oxidanylidene-4-thiophen-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(2,4-dimethoxyphenyl)-5-oxidanylidene-4-thiophen-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-1-(2,4-dimethoxyphenyl)-5-oxo-4-(3-thienyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-1-(2,4-dimethoxyphenyl)-5-oxo-4-(3-thiophenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-1-(2,4-dimethoxyphenyl)-5-oxo-4-thiophen-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-1-(2,4-dimethoxyphenyl)-5-keto-4-(3-thienyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2C3=C(C(C(=C2N)C#N)C4=CSC=C4)C(=O)CCC3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N2C3=C(C(C(=C2N)C#N)C4=CSC=C4)C(=O)CCC3)OC

InChI

InChI=1S/C22H21N3O3S/c1-27-14-6-7-16(19(10-14)28-2)25-17-4-3-5-18(26)21(17)20(13-8-9-29-12-13)15(11-23)22(25)24/h6-10,12,20H,3-5,24H2,1-2H3