1-[4-(diethylamino)-3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[4-(diethylamino)-3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[4-(diethylamino)-3-[(4-methoxyphenyl)sulfamoyl]phenyl]thiourea CAS Name: 1-[4-(diethylamino)-3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[4-(diethylamino)-3-[(4-methoxyphenyl)sulfamoyl]phenyl]thiourea Traditional Name: 1-benzyl-3-[4-(diethylamino)-3-[(4-methoxyphenyl)sulfamoyl]phenyl]thiourea Formula: C25H30N4O3S2 MolecularWeight: 498.6607

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)NC(=S)NCC2=CC=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)NC(=S)NCC2=CC=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C25H30N4O3S2/c1-4-29(5-2)23-16-13-21(27-25(33)26-18-19-9-7-6-8-10-19)17-24(23)34(30,31)28-20-11-14-22(32-3)15-12-20/h6-17,28H,4-5,18H2,1-3H3,(H2,26,27,33)