N-[4-(isoquinolin-1-ylmethylamino)-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-(isoquinolin-1-ylmethylamino)-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-(1-isoquinolylmethylamino)-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-(1-isoquinolinylmethylamino)-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-(isoquinolin-1-ylmethylamino)-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-(1-isoquinolylmethylamino)-4-keto-butyl]thiophene-3-carboxamide Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2CNC(=O)CCCNC(=O)C3=CSC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2CNC(=O)CCCNC(=O)C3=CSC=C3

InChI

InChI=1S/C19H19N3O2S/c23-18(6-3-9-21-19(24)15-8-11-25-13-15)22-12-17-16-5-2-1-4-14(16)7-10-20-17/h1-2,4-5,7-8,10-11,13H,3,6,9,12H2,(H,21,24)(H,22,23)