1-[2-(aziridin-1-yl)ethyl]-3-octadecyl-thiourea

Systemtic Name: 1-[2-(aziridin-1-yl)ethyl]-3-octadecyl-thiourea Openeye Name: 1-[2-(aziridin-1-yl)ethyl]-3-octadecyl-thiourea CAS Name: 1-[2-(1-aziridinyl)ethyl]-3-octadecylthiourea IUPAC Name: 1-[2-(aziridin-1-yl)ethyl]-3-octadecylthiourea Traditional Name: 1-(2-ethyleniminoethyl)-3-stearyl-thiourea Formula: C23H47N3S MolecularWeight: 397.70438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=S)NCCN1CC1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=S)NCCN1CC1

InChI

InChI=1S/C23H47N3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-23(27)25-19-20-26-21-22-26/h2-22H2,1H3,(H2,24,25,27)