N-(1,3-benzothiazol-2-yl)-N-(3,4-dimethylphenyl)-3-(phenylcarbamoylamino)propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(3,4-dimethylphenyl)-3-(phenylcarbamoylamino)propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(3,4-dimethylphenyl)-3-(phenylcarbamoylamino)propanamide CAS Name: 3-[[anilino(oxo)methyl]amino]-N-(1,3-benzothiazol-2-yl)-N-(3,4-dimethylphenyl)propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(3,4-dimethylphenyl)-3-(phenylcarbamoylamino)propanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(3,4-dimethylphenyl)-3-(phenylcarbamoylamino)propionamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCNC(=O)NC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCNC(=O)NC4=CC=CC=C4)C

InChI

InChI=1S/C25H24N4O2S/c1-17-12-13-20(16-18(17)2)29(25-28-21-10-6-7-11-22(21)32-25)23(30)14-15-26-24(31)27-19-8-4-3-5-9-19/h3-13,16H,14-15H2,1-2H3,(H2,26,27,31)