1-[1-(4-butan-2-ylphenyl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-[1-(4-butan-2-ylphenyl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-(2-methoxy-4-nitro-phenyl)-3-[1-(4-sec-butylphenyl)ethyl]thiourea CAS Name: 1-[1-(4-butan-2-ylphenyl)ethyl]-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-[1-(4-butan-2-ylphenyl)ethyl]-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-(2-methoxy-4-nitro-phenyl)-3-[1-(4-sec-butylphenyl)ethyl]thiourea Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(C)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(C)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C20H25N3O3S/c1-5-13(2)15-6-8-16(9-7-15)14(3)21-20(27)22-18-11-10-17(23(24)25)12-19(18)26-4/h6-14H,5H2,1-4H3,(H2,21,22,27)