1-[(2R)-2-methylheptyl]-3-[[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]thiourea

Systemtic Name: 1-[(2R)-2-methylheptyl]-3-[[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]thiourea Openeye Name: 1-[(2R)-2-methylheptyl]-3-[[(E)-3-(5-methyl-2-thienyl)prop-2-enoyl]amino]thiourea CAS Name: 1-[(2R)-2-methylheptyl]-3-[[(E)-3-(5-methyl-2-thiophenyl)-1-oxoprop-2-enyl]amino]thiourea IUPAC Name: 1-[(2R)-2-methylheptyl]-3-[[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]thiourea Traditional Name: 1-[(2R)-2-methylheptyl]-3-[[(E)-3-(5-methyl-2-thienyl)acryloyl]amino]thiourea Formula: C17H27N3OS2 MolecularWeight: 353.54578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CNC(=S)NNC(=O)C=CC1=CC=C(S1)C

Isomeric SMILES

CCCCC[C@@H](C)CNC(=S)NNC(=O)/C=C/C1=CC=C(S1)C

InChI

InChI=1S/C17H27N3OS2/c1-4-5-6-7-13(2)12-18-17(22)20-19-16(21)11-10-15-9-8-14(3)23-15/h8-11,13H,4-7,12H2,1-3H3,(H,19,21)(H2,18,20,22)/b11-10+/t13-/m1/s1