3-(aminomethyl)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-1-phenyl-ethyl]benzamide

Systemtic Name: 3-(aminomethyl)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-1-phenyl-ethyl]benzamide Openeye Name: 3-(aminomethyl)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxo-1-phenyl-ethyl]benzamide CAS Name: 3-(aminomethyl)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxo-1-phenylethyl]benzamide IUPAC Name: 3-(aminomethyl)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxo-1-phenylethyl]benzamide Traditional Name: 3-(aminomethyl)-N-[2-(1,3-benzothiazol-2-ylamino)-2-keto-1-phenyl-ethyl]benzamide Formula: C23H20N4O2S MolecularWeight: 416.4955

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=NC3=CC=CC=C3S2)NC(=O)C4=CC(=CC=C4)CN

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=NC3=CC=CC=C3S2)NC(=O)C4=CC(=CC=C4)CN

InChI

InChI=1S/C23H20N4O2S/c24-14-15-7-6-10-17(13-15)21(28)26-20(16-8-2-1-3-9-16)22(29)27-23-25-18-11-4-5-12-19(18)30-23/h1-13,20H,14,24H2,(H,26,28)(H,25,27,29)