3-(aminomethyl)-2-(2-methylpropyl)-1-oxidanylidene-4-thiophen-2-yl-isoquinoline-6-carbonitrile

Systemtic Name: 3-(aminomethyl)-2-(2-methylpropyl)-1-oxidanylidene-4-thiophen-2-yl-isoquinoline-6-carbonitrile Openeye Name: 3-(aminomethyl)-2-isobutyl-1-oxo-4-(2-thienyl)isoquinoline-6-carbonitrile CAS Name: 3-(aminomethyl)-2-(2-methylpropyl)-1-oxo-4-thiophen-2-yl-6-isoquinolinecarbonitrile IUPAC Name: 3-(aminomethyl)-2-(2-methylpropyl)-1-oxo-4-thiophen-2-ylisoquinoline-6-carbonitrile Traditional Name: 3-(aminomethyl)-2-isobutyl-1-keto-4-(2-thienyl)isoquinoline-6-carbonitrile Formula: C19H19N3OS MolecularWeight: 337.43866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C2=C(C1=O)C=CC(=C2)C#N)C3=CC=CS3)CN

Isomeric SMILES

CC(C)CN1C(=C(C2=C(C1=O)C=CC(=C2)C#N)C3=CC=CS3)CN

InChI

InChI=1S/C19H19N3OS/c1-12(2)11-22-16(10-21)18(17-4-3-7-24-17)15-8-13(9-20)5-6-14(15)19(22)23/h3-8,12H,10-11,21H2,1-2H3