1-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-3-[(E)-thiophen-2-ylmethylideneamino]thiourea

Systemtic Name: 1-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-3-[(E)-thiophen-2-ylmethylideneamino]thiourea Openeye Name: 1-(2-chloro-5-morpholinosulfonyl-phenyl)-3-[(E)-2-thienylmethyleneamino]thiourea CAS Name: 1-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-3-[(E)-thiophen-2-ylmethylideneamino]thiourea IUPAC Name: 1-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-3-[(E)-thiophen-2-ylmethylideneamino]thiourea Traditional Name: 1-(2-chloro-5-morpholinosulfonyl-phenyl)-3-[(E)-2-thenylideneamino]thiourea Formula: C16H17ClN4O3S3 MolecularWeight: 444.97918

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=S)NN=CC3=CC=CS3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=S)N/N=C/C3=CC=CS3

InChI

InChI=1S/C16H17ClN4O3S3/c17-14-4-3-13(27(22,23)21-5-7-24-8-6-21)10-15(14)19-16(25)20-18-11-12-2-1-9-26-12/h1-4,9-11H,5-8H2,(H2,19,20,25)/b18-11+