N-[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)carbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[(3-amino-3-oxo-propyl)-benzyl-carbamothioyl]thiophene-2-carboxamide CAS Name: N-[[(3-amino-3-oxopropyl)-(phenylmethyl)amino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[(3-amino-3-oxopropyl)-benzylcarbamothioyl]thiophene-2-carboxamide Traditional Name: N-[(3-amino-3-keto-propyl)-benzyl-thiocarbamoyl]thiophene-2-carboxamide Formula: C16H17N3O2S2 MolecularWeight: 347.45508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC(=O)N)C(=S)NC(=O)C2=CC=CS2

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC(=O)N)C(=S)NC(=O)C2=CC=CS2

InChI

InChI=1S/C16H17N3O2S2/c17-14(20)8-9-19(11-12-5-2-1-3-6-12)16(22)18-15(21)13-7-4-10-23-13/h1-7,10H,8-9,11H2,(H2,17,20)(H,18,21,22)