(2S)-2-(1,3-benzothiazol-2-ylamino)-N-[(Z)-1-thiophen-2-ylpropylideneamino]propanamide

Systemtic Name: (2S)-2-(1,3-benzothiazol-2-ylamino)-N-[(Z)-1-thiophen-2-ylpropylideneamino]propanamide Openeye Name: (2S)-2-(1,3-benzothiazol-2-ylamino)-N-[(Z)-1-(2-thienyl)propylideneamino]propanamide CAS Name: (2S)-2-(1,3-benzothiazol-2-ylamino)-N-[(Z)-1-thiophen-2-ylpropylideneamino]propanamide IUPAC Name: (2S)-2-(1,3-benzothiazol-2-ylamino)-N-[(Z)-1-thiophen-2-ylpropylideneamino]propanamide Traditional Name: (2S)-2-(1,3-benzothiazol-2-ylamino)-N-[(Z)-1-(2-thienyl)propylideneamino]propionamide Formula: C17H18N4OS2 MolecularWeight: 358.48102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=O)C(C)NC1=NC2=CC=CC=C2S1)C3=CC=CS3

Isomeric SMILES

CC/C(=N/NC(=O)[C@H](C)NC1=NC2=CC=CC=C2S1)/C3=CC=CS3

InChI

InChI=1S/C17H18N4OS2/c1-3-12(14-9-6-10-23-14)20-21-16(22)11(2)18-17-19-13-7-4-5-8-15(13)24-17/h4-11H,3H2,1-2H3,(H,18,19)(H,21,22)/b20-12-/t11-/m0/s1