1-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-(2,3-dimethylphenyl)thiourea

Systemtic Name: 1-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-(2,3-dimethylphenyl)thiourea Openeye Name: 1-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-(2,3-dimethylphenyl)thiourea CAS Name: 1-[[3-(1,3-benzothiazol-2-yl)-1-oxopropyl]amino]-3-(2,3-dimethylphenyl)thiourea IUPAC Name: 1-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-(2,3-dimethylphenyl)thiourea Traditional Name: 1-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-(2,3-dimethylphenyl)thiourea Formula: C19H20N4OS2 MolecularWeight: 384.5183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NNC(=O)CCC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)NNC(=O)CCC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C19H20N4OS2/c1-12-6-5-8-14(13(12)2)21-19(25)23-22-17(24)10-11-18-20-15-7-3-4-9-16(15)26-18/h3-9H,10-11H2,1-2H3,(H,22,24)(H2,21,23,25)