1-(3,4-dimethylphenyl)-3-(3-oxidanylpropyl)thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-(3-oxidanylpropyl)thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-(3-hydroxypropyl)thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-(3-hydroxypropyl)thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-(3-hydroxypropyl)thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-(3-hydroxypropyl)thiourea Formula: C12H18N2OS MolecularWeight: 238.34912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCCCO)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCCCO)C

InChI

InChI=1S/C12H18N2OS/c1-9-4-5-11(8-10(9)2)14-12(16)13-6-3-7-15/h4-5,8,15H,3,6-7H2,1-2H3,(H2,13,14,16)