1-naphthalen-1-yl-3-[5-[(3-nitrophenyl)methyl]-1,3-thiazol-2-yl]thiourea

Systemtic Name: 1-naphthalen-1-yl-3-[5-[(3-nitrophenyl)methyl]-1,3-thiazol-2-yl]thiourea Openeye Name: 1-(1-naphthyl)-3-[5-[(3-nitrophenyl)methyl]thiazol-2-yl]thiourea CAS Name: 1-(1-naphthalenyl)-3-[5-[(3-nitrophenyl)methyl]-2-thiazolyl]thiourea IUPAC Name: 1-naphthalen-1-yl-3-[5-[(3-nitrophenyl)methyl]-1,3-thiazol-2-yl]thiourea Traditional Name: 1-(1-naphthyl)-3-[5-(3-nitrobenzyl)thiazol-2-yl]thiourea Formula: C21H16N4O2S2 MolecularWeight: 420.50734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=S)NC3=NC=C(S3)CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=S)NC3=NC=C(S3)CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O2S2/c26-25(27)16-8-3-5-14(11-16)12-17-13-22-21(29-17)24-20(28)23-19-10-4-7-15-6-1-2-9-18(15)19/h1-11,13H,12H2,(H2,22,23,24,28)