1-[[4-[bis[3-(dimethylamino)propyl]sulfamoyl]-2-nitro-phenyl]amino]-3-(diphenylmethyl)thiourea

Systemtic Name: 1-[[4-[bis[3-(dimethylamino)propyl]sulfamoyl]-2-nitro-phenyl]amino]-3-(diphenylmethyl)thiourea Openeye Name: 1-benzhydryl-3-[4-[bis[3-(dimethylamino)propyl]sulfamoyl]-2-nitro-anilino]thiourea CAS Name: 1-[4-[bis[3-(dimethylamino)propyl]sulfamoyl]-2-nitroanilino]-3-(diphenylmethyl)thiourea IUPAC Name: 1-benzhydryl-3-[4-[bis[3-(dimethylamino)propyl]sulfamoyl]-2-nitroanilino]thiourea Traditional Name: 1-benzhydryl-3-[4-[bis[3-(dimethylamino)propyl]sulfamoyl]-2-nitro-anilino]thiourea Formula: C30H41N7O4S2 MolecularWeight: 627.82104

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(CCCN(C)C)S(=O)(=O)C1=CC(=C(C=C1)NNC(=S)NC(C2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCCN(CCCN(C)C)S(=O)(=O)C1=CC(=C(C=C1)NNC(=S)NC(C2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C30H41N7O4S2/c1-34(2)19-11-21-36(22-12-20-35(3)4)43(40,41)26-17-18-27(28(23-26)37(38)39)32-33-30(42)31-29(24-13-7-5-8-14-24)25-15-9-6-10-16-25/h5-10,13-18,23,29,32H,11-12,19-22H2,1-4H3,(H2,31,33,42)