1-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-(4-phenoxyphenyl)thiourea

Systemtic Name: 1-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-(4-phenoxyphenyl)thiourea CAS Name: 1-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-(4-phenoxyphenyl)thiourea Formula: C22H16ClN3O2S2 MolecularWeight: 453.96434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NNC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NNC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C22H16ClN3O2S2/c23-19-17-8-4-5-9-18(17)30-20(19)21(27)25-26-22(29)24-14-10-12-16(13-11-14)28-15-6-2-1-3-7-15/h1-13H,(H,25,27)(H2,24,26,29)