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

Systemtic Name: 1-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-(4-methoxyphenyl)thiourea Formula: C17H14ClN3O2S2 MolecularWeight: 391.89496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C17H14ClN3O2S2/c1-23-11-8-6-10(7-9-11)19-17(24)21-20-16(22)15-14(18)12-4-2-3-5-13(12)25-15/h2-9H,1H3,(H,20,22)(H2,19,21,24)