1-(1,3-benzothiazol-2-ylamino)-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea

Systemtic Name: 1-(1,3-benzothiazol-2-ylamino)-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Openeye Name: 1-(1,3-benzothiazol-2-ylamino)-3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]urea CAS Name: 1-(1,3-benzothiazol-2-ylamino)-3-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]urea IUPAC Name: 1-(1,3-benzothiazol-2-ylamino)-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Traditional Name: 1-(1,3-benzothiazol-2-ylamino)-3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]urea Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NNC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NNC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H22N4OS/c1-13(2)14-8-7-9-15(12-14)20(3,4)22-18(25)23-24-19-21-16-10-5-6-11-17(16)26-19/h5-12H,1H2,2-4H3,(H,21,24)(H2,22,23,25)