1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-nitrophenyl)thiourea CAS Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-nitrophenyl)thiourea Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O4S/c1-10(11-2-7-14-15(8-11)23-9-22-14)17-16(24)18-12-3-5-13(6-4-12)19(20)21/h2-8,10H,9H2,1H3,(H2,17,18,24)