1-(2,5-dimethylphenyl)-3-(4-phenylazanylphenyl)thiourea

Systemtic Name: 1-(2,5-dimethylphenyl)-3-(4-phenylazanylphenyl)thiourea Openeye Name: 1-(4-anilinophenyl)-3-(2,5-dimethylphenyl)thiourea CAS Name: 1-(4-anilinophenyl)-3-(2,5-dimethylphenyl)thiourea IUPAC Name: 1-(4-anilinophenyl)-3-(2,5-dimethylphenyl)thiourea Traditional Name: 1-(4-anilinophenyl)-3-(2,5-dimethylphenyl)thiourea Formula: C21H21N3S MolecularWeight: 347.47654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3

InChI

InChI=1S/C21H21N3S/c1-15-8-9-16(2)20(14-15)24-21(25)23-19-12-10-18(11-13-19)22-17-6-4-3-5-7-17/h3-14,22H,1-2H3,(H2,23,24,25)