2-[2-[(3-azanyl-3-oxidanylidene-propyl)-(4-methoxyphenyl)amino]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[(3-azanyl-3-oxidanylidene-propyl)-(4-methoxyphenyl)amino]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-(N-(3-amino-3-oxo-propyl)-4-methoxy-anilino)acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-(N-(3-amino-3-oxopropyl)-4-methoxyanilino)-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-(N-(3-amino-3-oxopropyl)-4-methoxyanilino)acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-(N-(3-amino-3-keto-propyl)-4-methoxy-anilino)acetyl]amino]thiophene-3-carboxamide Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CCC(=O)N)CC(=O)NC2=C(C=CS2)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)N(CCC(=O)N)CC(=O)NC2=C(C=CS2)C(=O)N

InChI

InChI=1S/C17H20N4O4S/c1-25-12-4-2-11(3-5-12)21(8-6-14(18)22)10-15(23)20-17-13(16(19)24)7-9-26-17/h2-5,7,9H,6,8,10H2,1H3,(H2,18,22)(H2,19,24)(H,20,23)