1-[1-[(3-chloranylphenoxy)methyl]pyrazol-4-yl]-3-naphthalen-1-yl-thiourea

Systemtic Name: 1-[1-[(3-chloranylphenoxy)methyl]pyrazol-4-yl]-3-naphthalen-1-yl-thiourea Openeye Name: 1-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]-3-(1-naphthyl)thiourea CAS Name: 1-[1-[(3-chlorophenoxy)methyl]-4-pyrazolyl]-3-(1-naphthalenyl)thiourea IUPAC Name: 1-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]-3-naphthalen-1-ylthiourea Traditional Name: 1-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]-3-(1-naphthyl)thiourea Formula: C21H17ClN4OS MolecularWeight: 408.90388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=S)NC3=CN(N=C3)COC4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=S)NC3=CN(N=C3)COC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H17ClN4OS/c22-16-7-4-8-18(11-16)27-14-26-13-17(12-23-26)24-21(28)25-20-10-3-6-15-5-1-2-9-19(15)20/h1-13H,14H2,(H2,24,25,28)