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

Systemtic Name: 1-[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(3-nitrophenyl)thiourea Openeye Name: 1-[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(3-nitrophenyl)thiourea CAS Name: 1-[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(3-nitrophenyl)thiourea IUPAC Name: 1-[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(3-nitrophenyl)thiourea Traditional Name: 1-[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(3-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(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O4S/c1-10(11-5-6-14-15(7-11)23-9-22-14)17-16(24)18-12-3-2-4-13(8-12)19(20)21/h2-8,10H,9H2,1H3,(H2,17,18,24)/t10-/m0/s1