1-[(3-chloranyl-6-ethyl-1-benzothiophen-2-yl)carbonylamino]-3-(2,5-dimethylphenyl)thiourea

Systemtic Name: 1-[(3-chloranyl-6-ethyl-1-benzothiophen-2-yl)carbonylamino]-3-(2,5-dimethylphenyl)thiourea Openeye Name: 1-[(3-chloro-6-ethyl-benzothiophene-2-carbonyl)amino]-3-(2,5-dimethylphenyl)thiourea CAS Name: 1-[[(3-chloro-6-ethyl-1-benzothiophen-2-yl)-oxomethyl]amino]-3-(2,5-dimethylphenyl)thiourea IUPAC Name: 1-[(3-chloro-6-ethyl-1-benzothiophene-2-carbonyl)amino]-3-(2,5-dimethylphenyl)thiourea Traditional Name: 1-[(3-chloro-6-ethyl-benzothiophene-2-carbonyl)amino]-3-(2,5-dimethylphenyl)thiourea Formula: C20H20ClN3OS2 MolecularWeight: 417.9753

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=C(S2)C(=O)NNC(=S)NC3=C(C=CC(=C3)C)C)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=C(S2)C(=O)NNC(=S)NC3=C(C=CC(=C3)C)C)Cl

InChI

InChI=1S/C20H20ClN3OS2/c1-4-13-7-8-14-16(10-13)27-18(17(14)21)19(25)23-24-20(26)22-15-9-11(2)5-6-12(15)3/h5-10H,4H2,1-3H3,(H,23,25)(H2,22,24,26)