1-[(7-chloranyl-1,3-benzodioxol-5-yl)carbonylamino]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[(7-chloranyl-1,3-benzodioxol-5-yl)carbonylamino]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-[(7-chloro-1,3-benzodioxole-5-carbonyl)amino]-3-(4-isopropylphenyl)thiourea CAS Name: 1-[[(7-chloro-1,3-benzodioxol-5-yl)-oxomethyl]amino]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[(7-chloro-1,3-benzodioxole-5-carbonyl)amino]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[(7-chloropiperonyloyl)amino]-3-p-cumenyl-thiourea Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C18H18ClN3O3S/c1-10(2)11-3-5-13(6-4-11)20-18(26)22-21-17(23)12-7-14(19)16-15(8-12)24-9-25-16/h3-8,10H,9H2,1-2H3,(H,21,23)(H2,20,22,26)