3-[[1-[bis(thiophen-2-ylmethyl)amino]-1-oxidanylidene-hexan-2-yl]carbamoylamino]hex-5-enoic acid

Systemtic Name: 3-[[1-[bis(thiophen-2-ylmethyl)amino]-1-oxidanylidene-hexan-2-yl]carbamoylamino]hex-5-enoic acid Openeye Name: 3-[1-[bis(2-thienylmethyl)carbamoyl]pentylcarbamoylamino]hex-5-enoic acid CAS Name: 3-[[[[1-[bis(thiophen-2-ylmethyl)amino]-1-oxohexan-2-yl]amino]-oxomethyl]amino]-5-hexenoic acid IUPAC Name: 3-[[1-[bis(thiophen-2-ylmethyl)amino]-1-oxohexan-2-yl]carbamoylamino]hex-5-enoic acid Traditional Name: 3-[1-[bis(2-thenyl)carbamoyl]pentylcarbamoylamino]hex-5-enoic acid Formula: C23H31N3O4S2 MolecularWeight: 477.63994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)N(CC1=CC=CS1)CC2=CC=CS2)NC(=O)NC(CC=C)CC(=O)O

Isomeric SMILES

CCCCC(C(=O)N(CC1=CC=CS1)CC2=CC=CS2)NC(=O)NC(CC=C)CC(=O)O

InChI

InChI=1S/C23H31N3O4S2/c1-3-5-11-20(25-23(30)24-17(8-4-2)14-21(27)28)22(29)26(15-18-9-6-12-31-18)16-19-10-7-13-32-19/h4,6-7,9-10,12-13,17,20H,2-3,5,8,11,14-16H2,1H3,(H,27,28)(H2,24,25,30)