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

Systemtic Name: 1-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-(4-nitrophenyl)thiourea CAS Name: 1-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-(4-nitrophenyl)thiourea Formula: C16H11ClN4O3S2 MolecularWeight: 406.86654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H11ClN4O3S2/c17-13-11-3-1-2-4-12(11)26-14(13)15(22)19-20-16(25)18-9-5-7-10(8-6-9)21(23)24/h1-8H,(H,19,22)(H2,18,20,25)